C609-0255 Screening compound: N-[1-(4-benzylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]-3-fluorobenzamide

C609-0255 Screening compound: N-[1-(4-benzylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]-3-fluorobenzamide
C609-0255 Screening compound: N-[1-(4-benzylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]-3-fluorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C609-0255
N-[1-(4-benzylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]-3-fluorobenzamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

C609-0255

Molecular Formula

C25H28FN3OS (C25 H28 FN3 OS)

Compound Name

N-[1-(4-benzylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]-3-fluorobenzamide

IUPAC name

N-[1-(4-benzylpiperazin-1-yl)-1-(thiophen-2-yl)propan-2-yl]-3-fluorobenzamide

SMILES

CC(C(c1cccs1)N1CCN(Cc2ccccc2)CC1)NC(c1cc(F)ccc1)=O

InChI

InChI=1S/C25H28FN3OS/c1-19(27-25(30)21-9-5-10-22(26)17-21)24(23-11-6-16-31-23)29-14-12-28(13-15-29)18-20-7-3-2-4-8-20/h2-11,16-17,19,24H,12-15,18H2,1H3,(H,27,30)

InChI Key

MWWGIONUPWDDSS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04470827

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.58

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.073

Distribution Coefficient, logD

3.984

Water Solubility, LogSw

-4.05

Polar Surface Area

31.399

Acid Dissociation Constant (pKa)

11.21

Base Dissociation Constant (pKb)

6.76

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

32.00

C609-0255 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular

References: we are preparing a list of scientific research reports with C609-0255 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C609-0255?
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What is the minimum amount of C609-0255 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C609-0255
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C609-0255
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of C609-0255 available by request